data_nef_c19101_2m60 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 19094 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 1 FME C 1 2 GLY N stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 FME start . . 2 A 2 GLY middle . false 3 A 3 ALA middle . . 4 A 4 ILE middle . . 5 A 5 ALA middle . . 6 A 6 LYS middle . . 7 A 7 LEU middle . . 8 A 8 VAL middle . . 9 A 9 ALA middle . . 10 A 10 LYS middle . . 11 A 11 PHE middle . . 12 A 12 GLY middle . false 13 A 13 TRP middle . . 14 A 14 PRO middle . false 15 A 15 PHE middle . . 16 A 16 ILE middle . . 17 A 17 LYS middle . . 18 A 18 LYS middle . . 19 A 19 PHE middle . . 20 A 20 TYR middle . . 21 A 21 LYS middle . . 22 A 22 GLN middle . . 23 A 23 ILE middle . . 24 A 24 MET middle . . 25 A 25 GLN middle . . 26 A 26 PHE middle . . 27 A 27 ILE middle . . 28 A 28 GLY middle . false 29 A 29 GLN middle . . 30 A 30 GLY middle . false 31 A 31 TRP middle . . 32 A 32 THR middle . . 33 A 33 ILE middle . . 34 A 34 ASP middle . . 35 A 35 GLN middle . . 36 A 36 ILE middle . . 37 A 37 GLU middle . . 38 A 38 LYS middle . . 39 A 39 TRP middle . . 40 A 40 LEU middle . . 41 A 41 LYS middle . . 42 A 42 ARG middle . . 43 A 43 HIS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 FME HA H 1 4.5162 0.010 A 1 FME HBy H 1 2.1498 0.010 A 1 FME HBx H 1 2.0924 0.010 A 1 FME HGy H 1 2.7265 0.010 A 1 FME HGx H 1 2.6173 0.010 A 2 GLY H H 1 8.8423 0.010 A 2 GLY HAx H 1 4.0082 0.010 A 3 ALA H H 1 8.1981 0.010 A 3 ALA HA H 1 4.1368 0.010 A 3 ALA HB% H 1 1.4430 0.010 A 4 ILE H H 1 7.9569 0.010 A 4 ILE HA H 1 3.8142 0.010 A 4 ILE HB H 1 2.2133 0.010 A 4 ILE HD1% H 1 0.7709 0.010 A 4 ILE HG1y H 1 1.6411 0.010 A 4 ILE HG1x H 1 1.5138 0.010 A 4 ILE HG2% H 1 1.0380 0.010 A 5 ALA H H 1 7.9837 0.010 A 5 ALA HA H 1 4.0515 0.010 A 5 ALA HB% H 1 1.5076 0.010 A 6 LYS H H 1 7.7750 0.010 A 6 LYS HA H 1 4.1103 0.010 A 6 LYS HBy H 1 2.0279 0.010 A 6 LYS HBx H 1 1.8899 0.010 A 6 LYS HDy H 1 1.5930 0.010 A 6 LYS HDx H 1 1.4366 0.010 A 6 LYS HEx H 1 2.9474 0.010 A 6 LYS HEy H 1 2.9477 0.010 A 6 LYS HGy H 1 1.7174 0.010 A 6 LYS HGx H 1 1.6511 0.010 A 7 LEU H H 1 8.1498 0.010 A 7 LEU HA H 1 4.3101 0.010 A 7 LEU HBx H 1 2.2919 0.010 A 7 LEU HDx% H 1 1.5845 0.010 A 7 LEU HDy% H 1 1.1064 0.010 A 7 LEU HG H 1 2.1325 0.010 A 8 VAL H H 1 9.0110 0.010 A 8 VAL HA H 1 3.3753 0.010 A 8 VAL HB H 1 2.0253 0.010 A 8 VAL HGx% H 1 0.7218 0.010 A 8 VAL HGy% H 1 0.6870 0.010 A 9 ALA H H 1 7.8428 0.010 A 9 ALA HA H 1 4.1262 0.010 A 9 ALA HB% H 1 1.5159 0.010 A 10 LYS H H 1 7.1763 0.010 A 10 LYS HA H 1 4.1335 0.010 A 10 LYS HBy H 1 1.6798 0.010 A 10 LYS HBx H 1 1.5060 0.010 A 10 LYS HDx H 1 1.3594 0.010 A 10 LYS HDy H 1 1.4166 0.010 A 10 LYS HEy H 1 2.7829 0.010 A 10 LYS HEx H 1 2.6892 0.010 A 10 LYS HGy H 1 0.8149 0.010 A 10 LYS HGx H 1 0.6546 0.010 A 11 PHE H H 1 8.4345 0.010 A 11 PHE HA H 1 4.5631 0.010 A 11 PHE HBy H 1 3.3287 0.010 A 11 PHE HBx H 1 2.9417 0.010 A 11 PHE HDx H 1 7.3485 0.010 A 11 PHE HEx H 1 7.1857 0.010 A 11 PHE HZ H 1 7.3048 0.010 A 12 GLY H H 1 8.6619 0.010 A 12 GLY HAy H 1 4.6586 0.010 A 12 GLY HAx H 1 4.0403 0.010 A 13 TRP H H 1 9.2687 0.010 A 13 TRP HA H 1 4.8921 0.010 A 13 TRP HBx H 1 3.4020 0.010 A 13 TRP HD1 H 1 7.2981 0.010 A 13 TRP HE1 H 1 10.1717 0.010 A 13 TRP HE3 H 1 6.8695 0.010 A 13 TRP HH2 H 1 6.9636 0.010 A 13 TRP HZ2 H 1 7.4176 0.010 A 13 TRP HZ3 H 1 7.6502 0.010 A 14 PRO HBy H 1 2.2942 0.010 A 14 PRO HBx H 1 2.0396 0.010 A 14 PRO HDy H 1 4.0612 0.010 A 14 PRO HDx H 1 3.9800 0.010 A 14 PRO HGy H 1 2.3520 0.010 A 14 PRO HGx H 1 1.9205 0.010 A 15 PHE H H 1 8.1040 0.010 A 15 PHE HA H 1 4.2927 0.010 A 15 PHE HBy H 1 3.3620 0.010 A 15 PHE HBx H 1 3.0126 0.010 A 15 PHE HDx H 1 7.1957 0.010 A 15 PHE HEx H 1 7.1460 0.010 A 15 PHE HZ H 1 7.2300 0.010 A 16 ILE H H 1 7.6294 0.010 A 16 ILE HA H 1 3.7456 0.010 A 16 ILE HB H 1 2.3093 0.010 A 16 ILE HG2% H 1 1.0043 0.010 A 17 LYS H H 1 9.0008 0.010 A 17 LYS HA H 1 3.5251 0.010 A 17 LYS HBy H 1 1.1721 0.010 A 17 LYS HBx H 1 0.9527 0.010 A 17 LYS HGy H 1 1.4366 0.010 A 17 LYS HGx H 1 1.1758 0.010 A 18 LYS H H 1 7.2574 0.010 A 18 LYS HA H 1 3.7896 0.010 A 18 LYS HBy H 1 1.5190 0.010 A 18 LYS HBx H 1 1.4203 0.010 A 18 LYS HDx H 1 1.3628 0.010 A 18 LYS HEx H 1 2.7264 0.010 A 18 LYS HGy H 1 1.0120 0.010 A 18 LYS HGx H 1 0.5135 0.010 A 19 PHE H H 1 7.1573 0.010 A 19 PHE HA H 1 5.0408 0.010 A 19 PHE HBx H 1 2.9265 0.010 A 19 PHE HDx H 1 6.9250 0.010 A 19 PHE HEx H 1 7.1909 0.010 A 19 PHE HZ H 1 7.3403 0.010 A 20 TYR H H 1 7.3936 0.010 A 20 TYR HA H 1 3.7554 0.010 A 20 TYR HBy H 1 3.3650 0.010 A 20 TYR HBx H 1 2.9539 0.010 A 20 TYR HDx H 1 6.9765 0.010 A 20 TYR HEx H 1 6.8631 0.010 A 21 LYS H H 1 8.4317 0.010 A 21 LYS HA H 1 3.7398 0.010 A 21 LYS HBy H 1 1.7861 0.010 A 21 LYS HBx H 1 1.6400 0.010 A 21 LYS HEx H 1 2.9513 0.010 A 21 LYS HGy H 1 1.5032 0.010 A 21 LYS HGx H 1 1.3031 0.010 A 22 GLN H H 1 7.9143 0.010 A 22 GLN HA H 1 3.3269 0.010 A 22 GLN HBy H 1 1.8926 0.010 A 22 GLN HBx H 1 1.7394 0.010 A 22 GLN HE2y H 1 7.1718 0.010 A 22 GLN HE2x H 1 6.6635 0.010 A 22 GLN HGy H 1 2.2259 0.010 A 22 GLN HGx H 1 1.1366 0.010 A 23 ILE H H 1 8.3382 0.010 A 23 ILE HA H 1 3.1601 0.010 A 23 ILE HB H 1 1.6828 0.010 A 23 ILE HD1% H 1 0.9680 0.010 A 23 ILE HG1x H 1 1.7999 0.010 A 23 ILE HG2% H 1 0.7269 0.010 A 24 MET H H 1 8.0456 0.010 A 24 MET HA H 1 4.1514 0.010 A 24 MET HBy H 1 1.8973 0.010 A 24 MET HBx H 1 1.7612 0.010 A 24 MET HGx H 1 2.3332 0.010 A 25 GLN H H 1 7.4237 0.010 A 25 GLN HA H 1 3.8477 0.010 A 25 GLN HBy H 1 1.9760 0.010 A 25 GLN HBx H 1 1.7618 0.010 A 25 GLN HE2y H 1 6.9385 0.010 A 25 GLN HE2x H 1 6.8755 0.010 A 25 GLN HGy H 1 2.1985 0.010 A 25 GLN HGx H 1 1.6407 0.010 A 26 PHE H H 1 7.7854 0.010 A 26 PHE HA H 1 3.6447 0.010 A 26 PHE HBy H 1 2.5298 0.010 A 26 PHE HBx H 1 2.2284 0.010 A 26 PHE HDx H 1 5.7042 0.010 A 26 PHE HEx H 1 5.5341 0.010 A 26 PHE HZ H 1 5.4445 0.010 A 27 ILE H H 1 8.6719 0.010 A 27 ILE HA H 1 3.7642 0.010 A 27 ILE HB H 1 1.8606 0.010 A 27 ILE HD1% H 1 0.9496 0.010 A 27 ILE HG1y H 1 1.7656 0.010 A 27 ILE HG1x H 1 0.7792 0.010 A 27 ILE HG2% H 1 0.9176 0.010 A 28 GLY H H 1 8.0492 0.010 A 28 GLY HAx H 1 3.9644 0.010 A 29 GLN H H 1 7.6348 0.010 A 29 GLN HA H 1 4.4495 0.010 A 29 GLN HBx H 1 2.0955 0.010 A 29 GLN HE2y H 1 7.0301 0.010 A 29 GLN HE2x H 1 6.7030 0.010 A 29 GLN HGx H 1 2.4807 0.010 A 30 GLY H H 1 8.0131 0.010 A 30 GLY HAy H 1 4.3448 0.010 A 30 GLY HAx H 1 3.9188 0.010 A 31 TRP H H 1 8.3972 0.010 A 31 TRP HA H 1 4.7417 0.010 A 31 TRP HBy H 1 3.1480 0.010 A 31 TRP HBx H 1 2.6283 0.010 A 31 TRP HD1 H 1 7.0266 0.010 A 31 TRP HE1 H 1 9.9992 0.010 A 31 TRP HE3 H 1 6.4890 0.010 A 31 TRP HH2 H 1 6.4448 0.010 A 31 TRP HZ2 H 1 7.0844 0.010 A 31 TRP HZ3 H 1 5.8724 0.010 A 32 THR H H 1 8.5054 0.010 A 32 THR HA H 1 4.5188 0.010 A 32 THR HG2% H 1 1.3855 0.010 A 33 ILE H H 1 8.9159 0.010 A 33 ILE HA H 1 3.8766 0.010 A 33 ILE HB H 1 2.0350 0.010 A 33 ILE HD1% H 1 0.9822 0.010 A 33 ILE HG1x H 1 1.4599 0.010 A 33 ILE HG2% H 1 0.9876 0.010 A 34 ASP H H 1 8.2320 0.010 A 34 ASP HA H 1 4.4127 0.010 A 34 ASP HBx H 1 2.6040 0.010 A 35 GLN H H 1 7.7255 0.010 A 35 GLN HA H 1 3.8205 0.010 A 35 GLN HBx H 1 2.2856 0.010 A 35 GLN HE2y H 1 6.6942 0.010 A 35 GLN HE2x H 1 6.1734 0.010 A 35 GLN HGy H 1 2.1927 0.010 A 35 GLN HGx H 1 1.9853 0.010 A 36 ILE H H 1 8.4901 0.010 A 36 ILE HA H 1 3.7938 0.010 A 36 ILE HB H 1 2.1108 0.010 A 36 ILE HD1% H 1 0.8300 0.010 A 36 ILE HG1y H 1 2.3171 0.010 A 36 ILE HG1x H 1 0.9543 0.010 A 36 ILE HG2% H 1 1.0620 0.010 A 37 GLU H H 1 9.1793 0.010 A 37 GLU HA H 1 4.0333 0.010 A 37 GLU HBy H 1 2.4121 0.010 A 37 GLU HBx H 1 2.2813 0.010 A 37 GLU HGx H 1 2.9910 0.010 A 38 LYS H H 1 8.0454 0.010 A 38 LYS HA H 1 3.9717 0.010 A 38 LYS HBy H 1 1.8985 0.010 A 38 LYS HBx H 1 1.7640 0.010 A 38 LYS HDx H 1 1.6027 0.010 A 38 LYS HEx H 1 2.9430 0.010 A 38 LYS HGy H 1 1.5847 0.010 A 38 LYS HGx H 1 1.4386 0.010 A 39 TRP H H 1 7.7629 0.010 A 39 TRP HA H 1 3.9133 0.010 A 39 TRP HBy H 1 3.6625 0.010 A 39 TRP HBx H 1 3.3914 0.010 A 39 TRP HD1 H 1 7.4782 0.010 A 39 TRP HE1 H 1 10.4310 0.010 A 39 TRP HE3 H 1 7.0197 0.010 A 39 TRP HH2 H 1 6.7971 0.010 A 39 TRP HZ2 H 1 7.3007 0.010 A 39 TRP HZ3 H 1 6.1913 0.010 A 40 LEU H H 1 9.1098 0.010 A 40 LEU HA H 1 3.6690 0.010 A 40 LEU HBx H 1 1.9378 0.010 A 40 LEU HDx% H 1 0.9811 0.010 A 40 LEU HDy% H 1 0.6137 0.010 A 41 LYS H H 1 7.9768 0.010 A 41 LYS HA H 1 4.2328 0.010 A 41 LYS HBy H 1 2.0082 0.010 A 41 LYS HBx H 1 1.6705 0.010 A 41 LYS HGy H 1 1.8268 0.010 A 41 LYS HGx H 1 1.7734 0.010 A 42 ARG H H 1 7.2287 0.010 A 42 ARG HA H 1 4.3314 0.010 A 42 ARG HBx H 1 1.5637 0.010 A 42 ARG HDx H 1 3.0886 0.010 A 42 ARG HE H 1 7.1552 0.010 A 42 ARG HGx H 1 1.6455 0.010 A 43 HIS H H 1 7.5949 0.010 A 43 HIS HA H 1 4.2474 0.010 A 43 HIS HBy H 1 3.1246 0.010 A 43 HIS HBx H 1 2.2571 0.010 A 43 HIS HD1 H 1 6.9275 0.010 A 43 HIS HE1 H 1 6.1937 0.010 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 8 VAL HGx% A 13 TRP H 1.0 . 4.98 2 2 A 8 VAL HGx% A 13 TRP H 1.0 . 5.50 3 3 A 8 VAL HGx% A 13 TRP H 1.0 . 5.50 4 4 A 13 TRP H A 8 VAL HGy% 1.0 . 5.50 5 5 A 36 ILE HG1y A 37 GLU H 1.0 . 5.18 6 6 A 37 GLU H A 36 ILE HG2% 1.0 . 4.13 7 7 A 37 GLU H A 7 LEU HDy% 1.0 . 4.43 8 8 A 8 VAL H A 8 VAL HGy% 1.0 . 3.50 9 9 A 8 VAL H A 8 VAL HGy% 1.0 . 3.61 10 10 A 17 LYS H A 17 LYS HBy 1.0 . 3.62 11 11 A 17 LYS H A 16 ILE HG2% 1.0 . 3.99 12 12 A 17 LYS H A 17 LYS HGx 1.0 . 5.09 13 13 A 17 LYS H A 17 LYS HGy 1.0 . 5.09 14 14 A 8 VAL H A 9 ALA HB% 1.0 . 5.50 15 15 A 33 ILE H A 36 ILE HD1% 1.0 . 5.03 16 16 A 33 ILE H A 32 THR HG2% 1.0 . 5.16 17 17 A 33 ILE H A 32 THR HG2% 1.0 . 5.50 18 18 A 13 TRP H A 14 PRO HBx 1.0 . 5.50 19 19 A 13 TRP H A 16 ILE HB 1.0 . 5.50 20 20 A 37 GLU H A 7 LEU HBx 1.0 . 4.66 21 20 A 37 GLU H A 7 LEU HBy 1.0 . 4.66 22 21 A 37 GLU H A 36 ILE HB 1.0 . 3.52 23 22 A 8 VAL H A 8 VAL HB 1.0 . 3.09 24 23 A 8 VAL H A 7 LEU HG 1.0 . 5.05 25 24 A 17 LYS H A 16 ILE HB 1.0 . 4.15 26 25 A 33 ILE H A 33 ILE HB 1.0 . 3.15 27 26 A 37 GLU H A 33 ILE HA 1.0 . 4.63 28 27 A 39 TRP HBy A 40 LEU H 1.0 . 4.11 29 28 A 8 VAL H A 4 ILE HA 1.0 . 4.74 30 29 A 40 LEU H A 36 ILE HA 1.0 . 4.85 31 30 A 13 TRP H A 14 PRO HDx 1.0 . 3.48 32 31 A 13 TRP H A 14 PRO HDy 1.0 . 3.48 33 32 A 40 LEU H A 38 LYS HA 1.0 . 4.87 34 33 A 40 LEU H A 37 GLU HA 1.0 . 4.00 35 34 A 37 GLU H A 34 ASP HA 1.0 . 4.45 36 35 A 8 VAL H A 5 ALA HA 1.0 . 3.98 37 36 A 8 VAL H A 6 LYS HA 1.0 . 4.95 38 37 A 33 ILE H A 32 THR HA 1.0 . 2.87 39 38 A 17 LYS H A 13 TRP HA 1.0 . 4.32 40 39 A 13 TRP H A 13 TRP HZ3 1.0 . 5.50 41 40 A 37 GLU H A 35 GLN H 1.0 . 4.82 42 41 A 37 GLU H A 39 TRP H 1.0 . 5.00 43 42 A 40 LEU H A 39 TRP H 1.0 . 3.30 44 43 A 40 LEU H A 42 ARG H 1.0 . 4.90 45 44 A 40 LEU H A 39 TRP HE3 1.0 . 3.83 46 45 A 8 VAL H A 10 LYS H 1.0 . 4.92 47 46 A 17 LYS H A 18 LYS H 1.0 . 3.39 48 47 A 17 LYS H A 16 ILE H 1.0 . 3.18 49 48 A 8 VAL H A 6 LYS H 1.0 . 4.79 50 49 A 33 ILE H A 35 GLN H 1.0 . 5.09 51 50 A 13 TRP H A 15 PHE H 1.0 . 5.25 52 51 A 13 TRP H A 12 GLY H 1.0 . 4.50 53 52 A 37 GLU H A 36 ILE H 1.0 . 3.28 54 53 A 37 GLU H A 38 LYS H 1.0 . 3.31 55 54 A 40 LEU H A 41 LYS H 1.0 . 3.38 56 55 A 40 LEU H A 38 LYS H 1.0 . 4.69 57 56 A 8 VAL H A 5 ALA H 1.0 . 5.13 58 57 A 17 LYS H A 15 PHE H 1.0 . 4.47 59 58 A 8 VAL H A 7 LEU H 1.0 . 3.25 60 59 A 33 ILE H A 32 THR H 1.0 . 4.90 61 60 A 12 GLY H A 10 LYS HBy 1.0 . 5.50 62 61 A 27 ILE H A 27 ILE HD1% 1.0 . 5.20 63 62 A 27 ILE H A 27 ILE HD1% 1.0 . 5.50 64 63 A 27 ILE H A 27 ILE HD1% 1.0 . 5.50 65 64 A 27 ILE H A 27 ILE HG2% 1.0 . 5.02 66 65 A 27 ILE H A 27 ILE HG2% 1.0 . 5.50 67 66 A 27 ILE H A 27 ILE HG2% 1.0 . 5.50 68 67 A 27 ILE H A 23 ILE HG2% 1.0 . 5.44 69 68 A 27 ILE H A 23 ILE HG2% 1.0 . 5.50 70 69 A 8 VAL HGx% A 12 GLY H 1.0 . 4.90 71 70 A 8 VAL HGx% A 12 GLY H 1.0 . 5.41 72 71 A 8 VAL HGx% A 12 GLY H 1.0 . 5.50 73 72 A 27 ILE H A 26 PHE HBy 1.0 . 4.44 74 73 A 27 ILE H A 26 PHE HBx 1.0 . 4.44 75 74 A 27 ILE H A 27 ILE HB 1.0 . 3.15 76 75 A 27 ILE H A 31 TRP HBy 1.0 . 4.65 77 76 A 12 GLY H A 11 PHE HBx 1.0 . 4.68 78 77 A 12 GLY H A 11 PHE HBy 1.0 . 4.68 79 78 A 12 GLY H A 8 VAL HA 1.0 . 3.59 80 79 A 27 ILE H A 24 MET HA 1.0 . 3.98 81 80 A 27 ILE H A 28 GLY HAx 1.0 . 4.98 82 80 A 27 ILE H A 28 GLY HAy 1.0 . 4.98 83 81 A 27 ILE H A 26 PHE HD% 1.0 . 4.78 84 82 A 10 LYS H A 12 GLY H 1.0 . 4.71 85 83 A 12 GLY H A 11 PHE HD% 1.0 . 4.86 86 84 A 27 ILE H A 25 GLN H 1.0 . 4.70 87 85 A 27 ILE H A 29 GLN H 1.0 . 4.84 88 86 A 27 ILE H A 26 PHE H 1.0 . 3.42 89 87 A 27 ILE H A 28 GLY H 1.0 . 3.43 90 88 A 12 GLY H A 11 PHE H 1.0 . 3.13 91 89 A 36 ILE HG1y A 36 ILE H 1.0 . 4.09 92 90 A 36 ILE HG2% A 36 ILE H 1.0 . 4.83 93 91 A 36 ILE HG2% A 36 ILE H 1.0 . 5.19 94 92 A 32 THR HG2% A 32 THR H 1.0 . 3.31 95 93 A 32 THR HG2% A 32 THR H 1.0 . 3.73 96 94 A 31 TRP H A 36 ILE HD1% 1.0 . 5.50 97 95 A 31 TRP H A 36 ILE HD1% 1.0 . 5.50 98 96 A 23 ILE H A 23 ILE HD1% 1.0 . 4.44 99 97 A 23 ILE H A 23 ILE HD1% 1.0 . 4.63 100 98 A 21 LYS H A 21 LYS HBy 1.0 . 3.82 101 99 A 23 ILE H A 23 ILE HG1y 1.0 . 3.25 102 100 A 23 ILE H A 23 ILE HB 1.0 . 3.21 103 101 A 36 ILE HB A 36 ILE H 1.0 . 3.35 104 102 A 36 ILE H A 36 ILE HG1x 1.0 . 3.24 105 103 A 31 TRP H A 29 GLN HGx 1.0 . 4.53 106 103 A 31 TRP H A 29 GLN HGy 1.0 . 4.53 107 104 A 31 TRP H A 29 GLN HBx 1.0 . 4.75 108 104 A 31 TRP H A 29 GLN HBy 1.0 . 4.75 109 105 A 11 PHE H A 7 LEU HBx 1.0 . 5.26 110 105 A 7 LEU HBy A 11 PHE H 1.0 . 5.26 111 106 A 21 LYS H A 20 TYR HBx 1.0 . 3.43 112 107 A 31 TRP H A 31 TRP HBx 1.0 . 4.05 113 108 A 11 PHE H A 11 PHE HBy 1.0 . 4.11 114 109 A 8 VAL HA A 11 PHE H 1.0 . 3.81 115 110 A 23 ILE H A 20 TYR HA 1.0 . 4.18 116 111 A 31 TRP H A 26 PHE HA 1.0 . 4.97 117 112 A 31 TRP H A 27 ILE HA 1.0 . 3.96 118 113 A 33 ILE HA A 36 ILE H 1.0 . 3.93 119 114 A 11 PHE H A 7 LEU HA 1.0 . 5.12 120 115 A 34 ASP HA A 36 ILE H 1.0 . 5.20 121 116 A 31 TRP H A 29 GLN HA 1.0 . 5.43 122 117 A 21 LYS H A 20 TYR HD% 1.0 . 5.03 123 118 A 31 TRP H A 31 TRP HD1 1.0 . 3.30 124 119 A 10 LYS H A 11 PHE H 1.0 . 3.40 125 120 A 36 ILE H A 31 TRP HE3 1.0 . 4.30 126 121 A 35 GLN H A 36 ILE H 1.0 . 3.36 127 122 A 36 ILE H A 38 LYS H 1.0 . 4.70 128 123 A 36 ILE H A 34 ASP H 1.0 . 4.80 129 124 A 21 LYS H A 22 GLN H 1.0 . 3.31 130 125 A 29 GLN H A 31 TRP H 1.0 . 4.46 131 126 A 31 TRP H A 30 GLY H 1.0 . 3.33 132 127 A 23 ILE H A 24 MET H 1.0 . 3.39 133 128 A 23 ILE H A 22 GLN H 1.0 . 3.28 134 129 A 8 VAL HGy% A 7 LEU H 1.0 . 5.39 135 130 A 8 VAL HGy% A 7 LEU H 1.0 . 5.50 136 131 A 7 LEU H A 7 LEU HDy% 1.0 . 4.44 137 132 A 7 LEU H A 7 LEU HDy% 1.0 . 5.11 138 133 A 32 THR HG2% A 34 ASP H 1.0 . 5.34 139 134 A 32 THR HG2% A 34 ASP H 1.0 . 5.50 140 135 A 7 LEU H A 7 LEU HDx% 1.0 . 4.12 141 136 A 7 LEU H A 5 ALA HB% 1.0 . 5.50 142 137 A 7 LEU H A 9 ALA HB% 1.0 . 5.50 143 138 A 23 ILE HG2% A 24 MET H 1.0 . 3.81 144 139 A 27 ILE HG2% A 28 GLY H 1.0 . 4.53 145 140 A 27 ILE HG2% A 28 GLY H 1.0 . 4.76 146 141 A 24 MET H A 23 ILE HD1% 1.0 . 5.07 147 142 A 5 ALA H A 4 ILE HG2% 1.0 . 4.90 148 143 A 5 ALA H A 4 ILE HG2% 1.0 . 5.34 149 144 A 22 GLN H A 22 GLN HGx 1.0 . 4.71 150 145 A 5 ALA H A 5 ALA HB% 1.0 . 2.79 151 146 A 4 ILE H A 4 ILE HG1x 1.0 . 4.02 152 147 A 4 ILE H A 3 ALA HB% 1.0 . 4.26 153 148 A 4 ILE H A 3 ALA HB% 1.0 . 4.83 154 149 A 4 ILE H A 4 ILE HG1y 1.0 . 4.02 155 150 A 23 ILE HB A 24 MET H 1.0 . 3.35 156 151 A 4 ILE HG2% A 4 ILE H 1.0 . 5.16 157 152 A 4 ILE HG2% A 4 ILE H 1.0 . 5.50 158 153 A 4 ILE HG2% A 4 ILE H 1.0 . 5.50 159 154 A 7 LEU H A 6 LYS HBx 1.0 . 4.38 160 155 A 15 PHE H A 14 PRO HGy 1.0 . 3.81 161 156 A 38 LYS H A 38 LYS HBy 1.0 . 3.71 162 157 A 38 LYS H A 38 LYS HBx 1.0 . 3.71 163 158 A 8 VAL HB A 9 ALA H 1.0 . 3.49 164 159 A 22 GLN H A 22 GLN HGy 1.0 . 4.71 165 160 A 30 GLY H A 29 GLN HGx 1.0 . 4.58 166 160 A 29 GLN HGy A 30 GLY H 1.0 . 4.58 167 161 A 16 ILE HB A 15 PHE H 1.0 . 5.16 168 162 A 15 PHE H A 14 PRO HGx 1.0 . 4.44 169 163 A 7 LEU H A 7 LEU HBx 1.0 . 3.45 170 163 A 7 LEU HBy A 7 LEU H 1.0 . 3.45 171 164 A 7 LEU HG A 7 LEU H 1.0 . 3.35 172 165 A 7 LEU H A 6 LYS HBy 1.0 . 4.38 173 166 A 33 ILE HB A 34 ASP H 1.0 . 3.71 174 167 A 15 PHE H A 15 PHE HBx 1.0 . 3.41 175 168 A 4 ILE HA A 7 LEU H 1.0 . 4.14 176 169 A 15 PHE H A 15 PHE HBy 1.0 . 3.41 177 170 A 20 TYR HA A 22 GLN H 1.0 . 4.24 178 171 A 20 TYR HA A 24 MET H 1.0 . 3.90 179 172 A 38 LYS H A 35 GLN HA 1.0 . 4.13 180 173 A 3 ALA H A 2 GLY HAx 1.0 . 3.23 181 173 A 2 GLY HAy A 3 ALA H 1.0 . 3.23 182 174 A 5 ALA HA A 7 LEU H 1.0 . 5.12 183 175 A 38 LYS HA A 41 LYS H 1.0 . 4.04 184 176 A 24 MET H A 20 TYR HBy 1.0 . 5.50 185 177 A 34 ASP HA A 38 LYS H 1.0 . 4.81 186 178 A 32 THR HA A 34 ASP H 1.0 . 5.33 187 179 A 22 GLN H A 19 PHE HA 1.0 . 5.04 188 180 A 35 GLN H A 34 ASP H 1.0 . 3.41 189 181 A 4 ILE H A 3 ALA H 1.0 . 3.36 190 182 A 16 ILE H A 15 PHE H 1.0 . 3.39 191 183 A 29 GLN H A 28 GLY H 1.0 . 3.58 192 184 A 25 GLN H A 24 MET H 1.0 . 3.28 193 185 A 42 ARG H A 41 LYS H 1.0 . 3.45 194 186 A 6 LYS H A 5 ALA H 1.0 . 3.29 195 187 A 29 GLN H A 30 GLY H 1.0 . 3.46 196 188 A 3 ALA H A 2 GLY H 1.0 . 3.69 197 189 A 33 ILE H A 34 ASP H 1.0 . 3.45 198 190 A 32 THR H A 34 ASP H 1.0 . 5.44 199 191 A 8 VAL HGy% A 9 ALA H 1.0 . 5.18 200 192 A 8 VAL HGy% A 9 ALA H 1.0 . 5.46 201 193 A 23 ILE HG2% A 26 PHE H 1.0 . 5.50 202 194 A 23 ILE HG2% A 26 PHE H 1.0 . 5.50 203 195 A 26 PHE H A 36 ILE HD1% 1.0 . 5.50 204 196 A 16 ILE HG2% A 13 TRP HZ3 1.0 . 4.90 205 197 A 16 ILE HG2% A 16 ILE H 1.0 . 4.06 206 198 A 43 HIS H A 42 ARG HBx 1.0 . 4.30 207 198 A 42 ARG HBy A 43 HIS H 1.0 . 4.30 208 199 A 32 THR HG2% A 35 GLN H 1.0 . 5.50 209 200 A 32 THR HG2% A 35 GLN H 1.0 . 5.50 210 201 A 16 ILE HB A 16 ILE H 1.0 . 3.12 211 202 A 29 GLN H A 29 GLN HBx 1.0 . 3.55 212 202 A 29 GLN H A 29 GLN HBy 1.0 . 3.55 213 203 A 29 GLN H A 29 GLN HGx 1.0 . 3.95 214 203 A 29 GLN H A 29 GLN HGy 1.0 . 3.95 215 204 A 35 GLN H A 34 ASP HBx 1.0 . 4.04 216 204 A 35 GLN H A 34 ASP HBy 1.0 . 4.04 217 205 A 35 GLN H A 35 GLN HBx 1.0 . 3.50 218 205 A 35 GLN H A 35 GLN HBy 1.0 . 3.50 219 206 A 13 TRP HZ3 A 13 TRP HBx 1.0 . 5.05 220 206 A 13 TRP HZ3 A 13 TRP HBy 1.0 . 5.05 221 207 A 16 ILE H A 15 PHE HBy 1.0 . 4.16 222 208 A 29 GLN H A 26 PHE HA 1.0 . 4.27 223 209 A 36 ILE HA A 39 TRP H 1.0 . 4.23 224 210 A 39 TRP H A 39 TRP HBx 1.0 . 3.39 225 211 A 39 TRP HBy A 39 TRP H 1.0 . 3.33 226 212 A 26 PHE H A 22 GLN HA 1.0 . 5.00 227 213 A 26 PHE H A 23 ILE HA 1.0 . 4.10 228 214 A 5 ALA HA A 9 ALA H 1.0 . 4.57 229 215 A 39 TRP H A 31 TRP HZ3 1.0 . 4.94 230 216 A 26 PHE HD% A 26 PHE H 1.0 . 3.86 231 217 A 25 GLN H A 26 PHE H 1.0 . 3.23 232 218 A 10 LYS H A 9 ALA H 1.0 . 3.42 233 219 A 42 ARG H A 43 HIS H 1.0 . 3.50 234 220 A 6 LYS H A 7 LEU H 1.0 . 3.37 235 221 A 39 TRP H A 38 LYS H 1.0 . 3.30 236 222 A 8 VAL H A 9 ALA H 1.0 . 3.30 237 223 A 16 ILE HG2% A 20 TYR H 1.0 . 5.50 238 224 A 20 TYR H A 23 ILE HD1% 1.0 . 4.40 239 225 A 11 PHE HZ A 40 LEU HDy% 1.0 . 5.36 240 226 A 11 PHE HZ A 40 LEU HDy% 1.0 . 5.50 241 227 A 11 PHE HD% A 7 LEU HDy% 1.0 . 4.56 242 228 A 11 PHE HD% A 7 LEU HDx% 1.0 . 4.52 243 229 A 25 GLN H A 25 GLN HGx 1.0 . 4.30 244 230 A 14 PRO HBx A 13 TRP HD1 1.0 . 5.50 245 231 A 25 GLN H A 25 GLN HGy 1.0 . 4.30 246 232 A 11 PHE HD% A 7 LEU HBx 1.0 . 4.38 247 232 A 7 LEU HBy A 11 PHE HD% 1.0 . 4.38 248 233 A 11 PHE HZ A 7 LEU HBx 1.0 . 5.20 249 233 A 7 LEU HBy A 11 PHE HZ 1.0 . 5.20 250 234 A 16 ILE HB A 18 LYS H 1.0 . 5.50 251 235 A 20 TYR HBx A 20 TYR H 1.0 . 3.24 252 236 A 13 TRP HD1 A 13 TRP HBx 1.0 . 3.21 253 236 A 13 TRP HBy A 13 TRP HD1 1.0 . 3.21 254 237 A 20 TYR HBy A 20 TYR H 1.0 . 2.93 255 238 A 25 GLN H A 22 GLN HA 1.0 . 4.10 256 239 A 39 TRP HBy A 39 TRP HD1 1.0 . 3.30 257 240 A 20 TYR H A 17 LYS HA 1.0 . 3.74 258 241 A 25 GLN H A 20 TYR HA 1.0 . 5.50 259 242 A 37 GLU HA A 11 PHE HZ 1.0 . 4.10 260 243 A 11 PHE HD% A 7 LEU HA 1.0 . 4.12 261 244 A 42 ARG H A 43 HIS HA 1.0 . 5.12 262 245 A 18 LYS H A 15 PHE HA 1.0 . 4.54 263 246 A 42 ARG H A 40 LEU HA 1.0 . 4.62 264 247 A 37 GLU HA A 11 PHE HD% 1.0 . 4.92 265 248 A 11 PHE HD% A 11 PHE HA 1.0 . 3.67 266 249 A 11 PHE HD% A 10 LYS HA 1.0 . 5.50 267 250 A 39 TRP HD1 A 26 PHE HEx 1.0 . 4.89 268 250 A 39 TRP HD1 A 26 PHE HEy 1.0 . 4.89 269 251 A 31 TRP HZ3 A 39 TRP HD1 1.0 . 3.91 270 252 A 39 TRP HZ2 A 26 PHE HEx 1.0 . 4.85 271 252 A 39 TRP HZ2 A 26 PHE HEy 1.0 . 4.85 272 253 A 39 TRP HD1 A 31 TRP HH2 1.0 . 3.53 273 254 A 20 TYR H A 19 PHE H 1.0 . 3.07 274 255 A 11 PHE HZ A 11 PHE HE% 1.0 . 2.40 275 256 A 21 LYS H A 20 TYR H 1.0 . 3.57 276 257 A 11 PHE HD% A 11 PHE H 1.0 . 3.57 277 258 A 41 LYS H A 11 PHE HZ 1.0 . 4.81 278 259 A 39 TRP H A 39 TRP HD1 1.0 . 5.24 279 260 A 25 GLN H A 23 ILE H 1.0 . 5.09 280 261 A 18 LYS H A 16 ILE H 1.0 . 4.93 281 262 A 13 TRP H A 13 TRP HD1 1.0 . 4.09 282 263 A 15 PHE HE% A 40 LEU HDx% 1.0 . 3.82 283 264 A 40 LEU HDy% A 11 PHE HE% 1.0 . 3.43 284 265 A 11 PHE HE% A 7 LEU HDy% 1.0 . 3.47 285 266 A 19 PHE HE% A 18 LYS HDx 1.0 . 4.43 286 266 A 18 LYS HDy A 19 PHE HE% 1.0 . 4.43 287 267 A 10 LYS H A 9 ALA HB% 1.0 . 4.39 288 268 A 10 LYS H A 9 ALA HB% 1.0 . 5.06 289 269 A 10 LYS H A 9 ALA HB% 1.0 . 5.02 290 270 A 42 ARG H A 42 ARG HBx 1.0 . 3.28 291 270 A 42 ARG H A 42 ARG HBy 1.0 . 3.28 292 271 A 39 TRP HE3 A 40 LEU HDx% 1.0 . 5.50 293 272 A 39 TRP HE3 A 40 LEU HDx% 1.0 . 5.50 294 273 A 36 ILE HG2% A 39 TRP HE3 1.0 . 4.64 295 274 A 40 LEU HDx% A 15 PHE HZ 1.0 . 4.41 296 275 A 10 LYS H A 10 LYS HBx 1.0 . 3.77 297 276 A 14 PRO HBy A 15 PHE HD% 1.0 . 5.04 298 277 A 31 TRP HD1 A 29 GLN HGx 1.0 . 3.78 299 277 A 29 GLN HGy A 31 TRP HD1 1.0 . 3.78 300 278 A 20 TYR HBy A 19 PHE H 1.0 . 5.09 301 279 A 20 TYR HBx A 19 PHE H 1.0 . 5.50 302 280 A 15 PHE HD% A 16 ILE HA 1.0 . 4.59 303 281 A 20 TYR HA A 19 PHE H 1.0 . 4.24 304 282 A 39 TRP HE3 A 40 LEU HA 1.0 . 3.26 305 283 A 7 LEU HA A 11 PHE HE% 1.0 . 4.37 306 284 A 37 GLU HA A 11 PHE HE% 1.0 . 3.87 307 285 A 11 PHE HA A 15 PHE HD% 1.0 . 5.15 308 286 A 31 TRP HD1 A 31 TRP HA 1.0 . 4.10 309 287 A 31 TRP HD1 A 30 GLY H 1.0 . 4.69 310 288 A 32 THR H A 31 TRP HD1 1.0 . 4.63 311 289 A 15 PHE H A 15 PHE HD% 1.0 . 5.33 312 290 A 26 PHE HZ A 39 TRP HE1 1.0 . 4.19 313 291 A 31 TRP HZ3 A 39 TRP HE1 1.0 . 5.36 314 292 A 31 TRP HH2 A 39 TRP HE1 1.0 . 5.02 315 293 A 26 PHE HD% A 31 TRP HE1 1.0 . 4.70 316 294 A 23 ILE HG2% A 23 ILE HD1% 1.0 . 2.95 317 295 A 8 VAL HGy% A 16 ILE HG2% 1.0 . 3.32 318 296 A 36 ILE HG2% A 36 ILE HD1% 1.0 . 4.62 319 297 A 36 ILE HG2% A 36 ILE HD1% 1.0 . 4.84 320 298 A 36 ILE HG1y A 36 ILE HG2% 1.0 . 3.14 321 299 A 7 LEU HDx% A 7 LEU HDy% 1.0 . 3.75 322 300 A 23 ILE HG2% A 23 ILE HG1y 1.0 . 4.05 323 301 A 36 ILE HG1y A 7 LEU HDy% 1.0 . 3.65 324 302 A 23 ILE HG2% A 23 ILE HD1% 1.0 . 3.47 325 303 A 16 ILE HG2% A 17 LYS HBx 1.0 . 3.88 326 304 A 16 ILE HG2% A 17 LYS HBx 1.0 . 4.14 327 305 A 36 ILE HG1y A 7 LEU HDx% 1.0 . 3.66 328 306 A 36 ILE HB A 36 ILE HD1% 1.0 . 3.60 329 307 A 7 LEU HBy A 7 LEU HDy% 1.0 . 3.89 330 307 A 7 LEU HDy% A 7 LEU HBx 1.0 . 3.89 331 308 A 8 VAL HGy% A 16 ILE HB 1.0 . 3.99 332 309 A 8 VAL HGy% A 16 ILE HB 1.0 . 4.37 333 310 A 36 ILE HD1% A 31 TRP HBx 1.0 . 4.26 334 311 A 31 TRP HBy A 36 ILE HD1% 1.0 . 4.52 335 312 A 31 TRP HBy A 36 ILE HD1% 1.0 . 4.79 336 313 A 23 ILE HA A 23 ILE HD1% 1.0 . 5.23 337 314 A 23 ILE HA A 23 ILE HD1% 1.0 . 5.50 338 315 A 23 ILE HA A 23 ILE HD1% 1.0 . 5.50 339 316 A 16 ILE HG2% A 8 VAL HA 1.0 . 4.69 340 317 A 16 ILE HG2% A 17 LYS HA 1.0 . 4.60 341 318 A 36 ILE HG2% A 39 TRP HBx 1.0 . 4.97 342 319 A 33 ILE HA A 36 ILE HD1% 1.0 . 3.64 343 320 A 8 VAL HGy% A 4 ILE HA 1.0 . 4.85 344 321 A 8 VAL HGy% A 4 ILE HA 1.0 . 5.17 345 322 A 24 MET HA A 27 ILE HG1x 1.0 . 4.34 346 323 A 27 ILE HG2% A 28 GLY HAx 1.0 . 4.67 347 323 A 27 ILE HG2% A 28 GLY HAy 1.0 . 4.67 348 324 A 27 ILE HG2% A 28 GLY HAy 1.0 . 4.91 349 324 A 27 ILE HG2% A 28 GLY HAx 1.0 . 4.91 350 325 A 27 ILE HG2% A 27 ILE HA 1.0 . 3.30 351 326 A 16 ILE HG2% A 16 ILE HA 1.0 . 4.08 352 327 A 4 ILE HA A 4 ILE HG2% 1.0 . 3.73 353 328 A 4 ILE HA A 4 ILE HG2% 1.0 . 4.16 354 329 A 36 ILE HG2% A 36 ILE HA 1.0 . 3.63 355 330 A 37 GLU HA A 7 LEU HDy% 1.0 . 4.47 356 331 A 33 ILE HA A 33 ILE HG2% 1.0 . 4.02 357 332 A 27 ILE HG2% A 24 MET HA 1.0 . 5.50 358 333 A 27 ILE HG2% A 24 MET HA 1.0 . 5.50 359 334 A 36 ILE HG2% A 37 GLU HA 1.0 . 4.79 360 335 A 33 ILE HA A 7 LEU HDy% 1.0 . 4.49 361 336 A 7 LEU HA A 7 LEU HDy% 1.0 . 3.50 362 337 A 7 LEU HA A 7 LEU HDy% 1.0 . 3.73 363 338 A 36 ILE HD1% A 31 TRP HE3 1.0 . 3.90 364 339 A 26 PHE HD% A 36 ILE HD1% 1.0 . 5.06 365 340 A 26 PHE HD% A 36 ILE HD1% 1.0 . 5.32 366 341 A 20 TYR HD% A 4 ILE HD1% 1.0 . 4.37 367 342 A 23 ILE HG2% A 20 TYR HD% 1.0 . 5.16 368 343 A 23 ILE HG2% A 20 TYR HD% 1.0 . 5.46 369 344 A 8 VAL HGx% A 13 TRP HZ3 1.0 . 4.97 370 345 A 8 VAL HGx% A 13 TRP HZ3 1.0 . 5.50 371 346 A 8 VAL HGx% A 13 TRP HZ3 1.0 . 5.50 372 347 A 8 VAL HGx% A 9 ALA H 1.0 . 5.50 373 348 A 8 VAL HGx% A 9 ALA H 1.0 . 5.50 374 349 A 8 VAL HGx% A 9 ALA H 1.0 . 5.50 375 350 A 8 VAL HGy% A 13 TRP HZ3 1.0 . 4.30 376 351 A 8 VAL HGy% A 13 TRP HZ3 1.0 . 4.63 377 352 A 23 ILE HG2% A 25 GLN H 1.0 . 4.98 378 353 A 40 LEU HDx% A 15 PHE HD% 1.0 . 5.50 379 354 A 40 LEU HDx% A 15 PHE HD% 1.0 . 5.50 380 355 A 20 TYR HD% A 23 ILE HD1% 1.0 . 5.50 381 356 A 20 TYR HD% A 4 ILE HG2% 1.0 . 5.50 382 357 A 16 ILE H A 17 LYS HBx 1.0 . 4.80 383 358 A 41 LYS H A 40 LEU HDx% 1.0 . 4.54 384 359 A 4 ILE H A 4 ILE HD1% 1.0 . 4.88 385 360 A 4 ILE H A 4 ILE HD1% 1.0 . 5.50 386 361 A 24 MET H A 23 ILE HD1% 1.0 . 5.50 387 362 A 33 ILE H A 33 ILE HG2% 1.0 . 5.27 388 363 A 33 ILE H A 33 ILE HG2% 1.0 . 5.50 389 364 A 33 ILE H A 33 ILE HG2% 1.0 . 5.50 390 365 A 36 ILE HG2% A 36 ILE H 1.0 . 5.50 391 366 A 27 ILE H A 36 ILE HD1% 1.0 . 4.51 392 367 A 36 ILE H A 36 ILE HD1% 1.0 . 4.01 393 368 A 36 ILE H A 36 ILE HD1% 1.0 . 4.61 394 369 A 23 ILE HG2% A 23 ILE H 1.0 . 5.16 395 370 A 23 ILE HG2% A 23 ILE H 1.0 . 5.50 396 371 A 23 ILE HG2% A 23 ILE H 1.0 . 5.50 397 372 A 8 VAL HGy% A 12 GLY H 1.0 . 5.06 398 373 A 8 VAL HGy% A 12 GLY H 1.0 . 5.50 399 374 A 40 LEU H A 40 LEU HDx% 1.0 . 5.37 400 375 A 40 LEU H A 40 LEU HDx% 1.0 . 5.50 401 376 A 36 ILE HG2% A 40 LEU H 1.0 . 5.50 402 377 A 36 ILE HG2% A 40 LEU H 1.0 . 5.50 403 378 A 37 GLU H A 33 ILE HG2% 1.0 . 5.50 404 379 A 37 GLU H A 33 ILE HG2% 1.0 . 5.50 405 380 A 37 GLU H A 36 ILE HD1% 1.0 . 5.50 406 381 A 37 GLU H A 36 ILE HD1% 1.0 . 5.50 407 382 A 32 THR HG2% A 32 THR HA 1.0 . 3.14 408 383 A 42 ARG HBy A 42 ARG HDx 1.0 . 3.26 409 383 A 42 ARG HBx A 42 ARG HDx 1.0 . 3.26 410 383 A 42 ARG HDy A 42 ARG HBx 1.0 . 3.26 411 383 A 42 ARG HBy A 42 ARG HDy 1.0 . 3.26 412 384 A 7 LEU HBy A 7 LEU HDx% 1.0 . 2.96 413 384 A 7 LEU HDx% A 7 LEU HBx 1.0 . 2.96 414 385 A 29 GLN HBy A 29 GLN HGx 1.0 . 2.69 415 385 A 29 GLN HBx A 29 GLN HGx 1.0 . 2.69 416 385 A 29 GLN HGy A 29 GLN HBx 1.0 . 2.69 417 385 A 29 GLN HGy A 29 GLN HBy 1.0 . 2.69 418 386 A 8 VAL HB A 5 ALA HA 1.0 . 4.02 419 387 A 34 ASP HA A 37 GLU HBy 1.0 . 4.90 420 388 A 26 PHE HA A 29 GLN HGx 1.0 . 3.92 421 388 A 29 GLN HGy A 26 PHE HA 1.0 . 3.92 422 389 A 8 VAL HGx% A 8 VAL H 1.0 . 5.21 423 390 A 8 VAL HGx% A 8 VAL H 1.0 . 5.50 424 391 A 8 VAL HGx% A 8 VAL H 1.0 . 5.50 425 392 A 31 TRP HE1 A 29 GLN HGx 1.0 . 4.37 426 392 A 29 GLN HGy A 31 TRP HE1 1.0 . 4.37 427 393 A 39 TRP HBy A 31 TRP HZ3 1.0 . 3.58 428 394 A 39 TRP HBx A 31 TRP HZ3 1.0 . 4.09 429 395 A 36 ILE HA A 31 TRP HZ3 1.0 . 4.12 430 396 A 36 ILE HA A 26 PHE HD% 1.0 . 4.72 431 397 A 26 PHE HD% A 26 PHE HA 1.0 . 3.06 432 398 A 15 PHE HA A 19 PHE HD% 1.0 . 5.50 433 399 A 8 VAL HGy% A 13 TRP HE3 1.0 . 3.89 434 400 A 4 ILE HD1% A 20 TYR HE% 1.0 . 5.11 435 401 A 4 ILE HD1% A 20 TYR HE% 1.0 . 5.50 436 402 A 4 ILE HD1% A 20 TYR HE% 1.0 . 5.50 437 403 A 20 TYR HD% A 23 ILE HD1% 1.0 . 4.24 438 404 A 16 ILE HG2% A 13 TRP HE3 1.0 . 3.54 439 405 A 16 ILE HG2% A 20 TYR HD% 1.0 . 3.65 440 406 A 20 TYR HD% A 4 ILE HG2% 1.0 . 4.72 441 407 A 19 PHE HD% A 18 LYS HBx 1.0 . 4.53 442 408 A 19 PHE HD% A 18 LYS HBy 1.0 . 4.53 443 409 A 39 TRP HE1 A 26 PHE HEx 1.0 . 4.82 444 410 A 8 VAL H A 9 ALA HA 1.0 . 5.50 445 411 A 40 LEU H A 39 TRP HBx 1.0 . 3.67 446 412 A 27 ILE HA A 30 GLY H 1.0 . 4.64 447 413 A 4 ILE HA A 6 LYS H 1.0 . 4.36 448 414 A 43 HIS H A 40 LEU HA 1.0 . 4.70 449 415 A 15 PHE HA A 15 PHE HD% 1.0 . 4.10 450 416 A 19 PHE H A 16 ILE HA 1.0 . 4.78 451 417 A 27 ILE H A 23 ILE HA 1.0 . 5.09 452 418 A 33 ILE HA A 35 GLN H 1.0 . 5.41 453 419 A 36 ILE HG1y A 31 TRP HE3 1.0 . 4.16 454 420 A 36 ILE HG2% A 31 TRP HE3 1.0 . 5.50 455 421 A 36 ILE HG2% A 31 TRP HE3 1.0 . 5.50 456 422 A 36 ILE HG1x A 31 TRP HE3 1.0 . 3.64 457 423 A 31 TRP HBx A 31 TRP HE3 1.0 . 3.70 458 424 A 39 TRP HBy A 31 TRP HE3 1.0 . 5.08 459 425 A 39 TRP HBy A 31 TRP HH2 1.0 . 4.94 460 426 A 40 LEU HA A 39 TRP HZ3 1.0 . 4.53 461 427 A 36 ILE HA A 31 TRP HE3 1.0 . 3.64 462 428 A 26 PHE HD% A 31 TRP HE3 1.0 . 4.95 463 429 A 31 TRP HH2 A 26 PHE HEx 1.0 . 4.59 464 429 A 31 TRP HH2 A 26 PHE HEy 1.0 . 4.59 465 430 A 31 TRP H A 31 TRP HE3 1.0 . 5.50 466 431 A 23 ILE HG2% A 26 PHE HD% 1.0 . 4.21 467 432 A 36 ILE HG1y A 26 PHE HD% 1.0 . 3.98 468 433 A 36 ILE HG2% A 26 PHE HD% 1.0 . 3.92 469 434 A 36 ILE HG2% A 26 PHE HD% 1.0 . 4.24 470 435 A 26 PHE HD% A 25 GLN HBx 1.0 . 5.18 471 436 A 26 PHE HD% A 36 ILE HG1x 1.0 . 4.78 472 437 A 36 ILE HB A 26 PHE HD% 1.0 . 5.21 473 438 A 26 PHE HD% A 25 GLN HBy 1.0 . 5.18 474 439 A 26 PHE HD% A 23 ILE HA 1.0 . 3.32 475 440 A 31 TRP HBx A 31 TRP HZ3 1.0 . 5.11 476 441 A 26 PHE HD% A 31 TRP HD1 1.0 . 5.08 477 442 A 36 ILE HG1y A 26 PHE HEx 1.0 . 5.15 478 442 A 36 ILE HG1y A 26 PHE HEy 1.0 . 5.15 479 443 A 36 ILE HG2% A 26 PHE HEy 1.0 . 4.80 480 443 A 36 ILE HG2% A 26 PHE HEx 1.0 . 4.80 481 444 A 36 ILE HG2% A 26 PHE HEy 1.0 . 5.47 482 444 A 36 ILE HG2% A 26 PHE HEx 1.0 . 5.47 483 445 A 39 TRP HZ2 A 26 PHE HZ 1.0 . 4.78 484 446 A 26 PHE HEx A 31 TRP HZ2 1.0 . 4.94 485 446 A 31 TRP HZ2 A 26 PHE HEy 1.0 . 4.94 486 447 A 19 PHE HA A 19 PHE HD% 1.0 . 3.72 487 448 A 34 ASP HA A 33 ILE HG2% 1.0 . 5.50 488 449 A 34 ASP HA A 33 ILE HG2% 1.0 . 5.50 489 450 A 23 ILE HG2% A 24 MET HA 1.0 . 4.46 490 451 A 8 VAL HGy% A 5 ALA HA 1.0 . 4.38 491 452 A 24 MET HA A 27 ILE HG1y 1.0 . 4.34 492 453 A 5 ALA HA A 4 ILE HG2% 1.0 . 4.89 493 454 A 5 ALA HA A 4 ILE HG2% 1.0 . 5.30 494 455 A 29 GLN HA A 29 GLN HGx 1.0 . 3.53 495 455 A 29 GLN HGy A 29 GLN HA 1.0 . 3.53 496 456 A 34 ASP HA A 37 GLU HBx 1.0 . 4.90 497 457 A 36 ILE HB A 33 ILE HA 1.0 . 4.25 498 458 A 26 PHE HA A 29 GLN HBx 1.0 . 3.86 499 458 A 29 GLN HBy A 26 PHE HA 1.0 . 3.86 500 459 A 23 ILE HB A 20 TYR HA 1.0 . 3.81 501 460 A 16 ILE HB A 8 VAL HA 1.0 . 4.88 502 461 A 40 LEU HA A 40 LEU HDx% 1.0 . 4.06 503 462 A 40 LEU HA A 40 LEU HDx% 1.0 . 4.55 504 463 A 4 ILE HA A 7 LEU HDx% 1.0 . 3.98 505 464 A 4 ILE HA A 4 ILE HD1% 1.0 . 4.16 506 465 A 4 ILE HA A 4 ILE HD1% 1.0 . 4.75 507 466 A 23 ILE HG2% A 20 TYR HA 1.0 . 4.75 508 467 A 23 ILE HG2% A 20 TYR HA 1.0 . 5.06 509 468 A 16 ILE HG2% A 20 TYR HBy 1.0 . 5.25 510 469 A 20 TYR HA A 23 ILE HD1% 1.0 . 3.34 511 470 A 8 VAL HGy% A 8 VAL HA 1.0 . 3.83 512 471 A 8 VAL HGy% A 8 VAL HA 1.0 . 3.97 513 472 A 20 TYR HBy A 17 LYS HBx 1.0 . 4.67 514 473 A 23 ILE HG2% A 23 ILE HA 1.0 . 3.44 515 474 A 36 ILE HG2% A 23 ILE HA 1.0 . 4.81 516 475 A 36 ILE HG2% A 23 ILE HA 1.0 . 5.07 517 476 A 23 ILE HG1y A 23 ILE HA 1.0 . 4.00 518 477 A 36 ILE HG1x A 31 TRP HBx 1.0 . 3.91 519 478 A 20 TYR HBy A 17 LYS HA 1.0 . 3.50 520 479 A 26 PHE HA A 26 PHE HEx 1.0 . 4.57 521 479 A 26 PHE HA A 26 PHE HEy 1.0 . 4.57 522 480 A 23 ILE HA A 26 PHE HEx 1.0 . 4.61 523 480 A 23 ILE HA A 26 PHE HEy 1.0 . 4.61 524 481 A 20 TYR HD% A 17 LYS HA 1.0 . 4.29 525 482 A 20 TYR HA A 20 TYR HD% 1.0 . 3.79 526 483 A 39 TRP HE3 A 39 TRP HBx 1.0 . 3.79 527 484 A 15 PHE HD% A 11 PHE HBy 1.0 . 4.13 528 485 A 15 PHE HD% A 11 PHE HBx 1.0 . 4.13 529 486 A 16 ILE H A 15 PHE HBx 1.0 . 4.16 530 487 A 11 PHE H A 11 PHE HBx 1.0 . 4.11 531 488 A 32 THR H A 31 TRP HBx 1.0 . 3.87 532 489 A 13 TRP H A 13 TRP HBx 1.0 . 3.30 533 489 A 13 TRP H A 13 TRP HBy 1.0 . 3.30 534 490 A 42 ARG HA A 42 ARG HDx 1.0 . 4.83 535 490 A 42 ARG HDy A 42 ARG HA 1.0 . 4.83 536 491 A 20 TYR HBx A 17 LYS HA 1.0 . 4.16 537 492 A 8 VAL H A 4 ILE HG2% 1.0 . 4.71 538 493 A 8 VAL H A 4 ILE HG2% 1.0 . 5.40 539 494 A 8 VAL H A 7 LEU HDy% 1.0 . 5.50 540 495 A 8 VAL H A 7 LEU HDy% 1.0 . 5.50 541 496 A 8 VAL H A 9 ALA HB% 1.0 . 4.47 542 497 A 8 VAL H A 7 LEU HBx 1.0 . 3.70 543 497 A 8 VAL H A 7 LEU HBy 1.0 . 3.70 544 498 A 32 THR H A 31 TRP HBy 1.0 . 4.28 545 499 A 27 ILE H A 29 GLN HBx 1.0 . 4.84 546 499 A 27 ILE H A 29 GLN HBy 1.0 . 4.84 547 500 A 31 TRP HBy A 31 TRP H 1.0 . 3.79 548 501 A 4 ILE H A 4 ILE HB 1.0 . 3.60 549 502 A 5 ALA H A 4 ILE HB 1.0 . 4.06 550 503 A 23 ILE HG1y A 22 GLN H 1.0 . 4.26 551 504 A 14 PRO HGy A 15 PHE HD% 1.0 . 4.82 552 505 A 11 PHE HD% A 10 LYS HBx 1.0 . 4.88 553 506 A 10 LYS HBy A 11 PHE HD% 1.0 . 4.31 554 507 A 10 LYS H A 10 LYS HBy 1.0 . 3.47 555 508 A 8 VAL HA A 7 LEU HBx 1.0 . 4.28 556 508 A 7 LEU HBy A 8 VAL HA 1.0 . 4.28 557 509 A 21 LYS H A 21 LYS HBx 1.0 . 3.82 558 510 A 3 ALA HB% A 3 ALA H 1.0 . 3.52 559 511 A 3 ALA HB% A 3 ALA H 1.0 . 3.67 560 512 A 9 ALA HB% A 9 ALA H 1.0 . 3.54 561 513 A 9 ALA HB% A 9 ALA H 1.0 . 3.91 562 514 A 6 LYS H A 5 ALA HB% 1.0 . 4.23 563 515 A 6 LYS H A 5 ALA HB% 1.0 . 4.67 564 516 A 2 GLY H A 4 ILE HG1x 1.0 . 4.52 565 516 A 2 GLY H A 4 ILE HG1y 1.0 . 4.52 566 517 A 3 ALA H A 27 ILE HG1x 1.0 . 5.34 567 517 A 3 ALA H A 27 ILE HG1y 1.0 . 5.34 568 518 A 3 ALA HB% A 27 ILE HG1x 1.0 . 3.61 569 518 A 3 ALA HB% A 27 ILE HG1y 1.0 . 3.61 570 519 A 4 ILE H A 4 ILE HG1x 1.0 . 3.24 571 519 A 4 ILE H A 4 ILE HG1y 1.0 . 3.24 572 520 A 4 ILE HG2% A 4 ILE HG1y 1.0 . 3.70 573 520 A 4 ILE HG2% A 4 ILE HG1x 1.0 . 3.70 574 521 A 20 TYR HE% A 4 ILE HG1x 1.0 . 4.83 575 521 A 20 TYR HE% A 4 ILE HG1y 1.0 . 4.83 576 522 A 6 LYS H A 6 LYS HBx 1.0 . 3.26 577 522 A 6 LYS H A 6 LYS HBy 1.0 . 3.26 578 523 A 6 LYS H A 6 LYS HGy 1.0 . 3.43 579 523 A 6 LYS H A 6 LYS HGx 1.0 . 3.43 580 524 A 7 LEU H A 6 LYS HBx 1.0 . 3.58 581 524 A 7 LEU H A 6 LYS HBy 1.0 . 3.58 582 525 A 7 LEU HBy A 37 GLU HGx 1.0 . 4.03 583 525 A 37 GLU HGy A 7 LEU HBx 1.0 . 4.03 584 525 A 7 LEU HBy A 37 GLU HGy 1.0 . 4.03 585 525 A 7 LEU HBx A 37 GLU HGx 1.0 . 4.03 586 526 A 7 LEU HDy% A 37 GLU HBy 1.0 . 4.92 587 526 A 7 LEU HDy% A 37 GLU HBx 1.0 . 4.92 588 527 A 7 LEU HDy% A 37 GLU HGy 1.0 . 3.99 589 527 A 7 LEU HDy% A 37 GLU HGx 1.0 . 3.99 590 528 A 9 ALA HB% A 10 LYS HGy 1.0 . 5.34 591 528 A 9 ALA HB% A 10 LYS HGx 1.0 . 5.34 592 529 A 12 GLY H A 11 PHE HBx 1.0 . 4.08 593 529 A 12 GLY H A 11 PHE HBy 1.0 . 4.08 594 530 A 15 PHE HD% A 11 PHE HBx 1.0 . 3.55 595 530 A 15 PHE HD% A 11 PHE HBy 1.0 . 3.55 596 531 A 15 PHE HE% A 11 PHE HBx 1.0 . 4.93 597 531 A 15 PHE HE% A 11 PHE HBy 1.0 . 4.93 598 532 A 11 PHE HE% A 37 GLU HBx 1.0 . 4.81 599 532 A 11 PHE HE% A 37 GLU HBy 1.0 . 4.81 600 533 A 11 PHE HZ A 37 GLU HBx 1.0 . 4.52 601 533 A 11 PHE HZ A 37 GLU HBy 1.0 . 4.52 602 534 A 11 PHE HZ A 37 GLU HGx 1.0 . 4.67 603 534 A 11 PHE HZ A 37 GLU HGy 1.0 . 4.67 604 535 A 11 PHE HZ A 40 LEU HBx 1.0 . 4.49 605 535 A 11 PHE HZ A 40 LEU HBy 1.0 . 4.49 606 536 A 13 TRP H A 14 PRO HDx 1.0 . 2.91 607 536 A 13 TRP H A 14 PRO HDy 1.0 . 2.91 608 537 A 13 TRP HBy A 14 PRO HDx 1.0 . 3.27 609 537 A 13 TRP HBx A 14 PRO HDx 1.0 . 3.27 610 537 A 14 PRO HDy A 13 TRP HBx 1.0 . 3.27 611 537 A 13 TRP HBy A 14 PRO HDy 1.0 . 3.27 612 538 A 13 TRP HD1 A 14 PRO HDx 1.0 . 3.87 613 538 A 13 TRP HD1 A 14 PRO HDy 1.0 . 3.87 614 539 A 15 PHE H A 14 PRO HDx 1.0 . 4.07 615 539 A 15 PHE H A 14 PRO HDy 1.0 . 4.07 616 540 A 17 LYS H A 14 PRO HDx 1.0 . 5.35 617 540 A 17 LYS H A 14 PRO HDy 1.0 . 5.35 618 541 A 15 PHE H A 15 PHE HBx 1.0 . 2.98 619 541 A 15 PHE H A 15 PHE HBy 1.0 . 2.98 620 542 A 15 PHE HA A 17 LYS HGx 1.0 . 5.34 621 542 A 15 PHE HA A 17 LYS HGy 1.0 . 5.34 622 543 A 15 PHE HA A 18 LYS HBx 1.0 . 4.23 623 543 A 15 PHE HA A 18 LYS HBy 1.0 . 4.23 624 544 A 16 ILE H A 15 PHE HBx 1.0 . 3.50 625 544 A 16 ILE H A 15 PHE HBy 1.0 . 3.50 626 545 A 15 PHE HE% A 40 LEU HBx 1.0 . 5.06 627 545 A 15 PHE HE% A 40 LEU HBy 1.0 . 5.06 628 546 A 16 ILE H A 17 LYS HGx 1.0 . 5.25 629 546 A 16 ILE H A 17 LYS HGy 1.0 . 5.25 630 547 A 16 ILE HA A 18 LYS HBx 1.0 . 5.21 631 547 A 16 ILE HA A 18 LYS HBy 1.0 . 5.21 632 548 A 17 LYS H A 18 LYS HBx 1.0 . 5.34 633 548 A 17 LYS H A 18 LYS HBy 1.0 . 5.34 634 549 A 18 LYS H A 17 LYS HGx 1.0 . 3.49 635 549 A 18 LYS H A 17 LYS HGy 1.0 . 3.49 636 550 A 18 LYS HA A 17 LYS HGx 1.0 . 4.11 637 550 A 17 LYS HGy A 18 LYS HA 1.0 . 4.11 638 551 A 19 PHE H A 17 LYS HGx 1.0 . 4.81 639 551 A 19 PHE H A 17 LYS HGy 1.0 . 4.81 640 552 A 18 LYS H A 18 LYS HBx 1.0 . 3.28 641 552 A 18 LYS H A 18 LYS HBy 1.0 . 3.28 642 553 A 18 LYS H A 18 LYS HGy 1.0 . 4.77 643 553 A 18 LYS H A 18 LYS HGx 1.0 . 4.77 644 554 A 19 PHE HD% A 18 LYS HBx 1.0 . 3.83 645 554 A 19 PHE HD% A 18 LYS HBy 1.0 . 3.83 646 555 A 19 PHE HD% A 18 LYS HGy 1.0 . 4.73 647 555 A 19 PHE HD% A 18 LYS HGx 1.0 . 4.73 648 556 A 19 PHE HD% A 22 GLN HBy 1.0 . 5.32 649 556 A 19 PHE HD% A 22 GLN HBx 1.0 . 5.32 650 557 A 19 PHE HD% A 22 GLN HGx 1.0 . 4.73 651 557 A 19 PHE HD% A 22 GLN HGy 1.0 . 4.73 652 558 A 20 TYR HA A 24 MET HBy 1.0 . 4.46 653 558 A 20 TYR HA A 24 MET HBx 1.0 . 4.46 654 559 A 20 TYR HD% A 24 MET HBy 1.0 . 4.39 655 559 A 20 TYR HD% A 24 MET HBx 1.0 . 4.39 656 560 A 20 TYR HE% A 24 MET HBy 1.0 . 4.31 657 560 A 20 TYR HE% A 24 MET HBx 1.0 . 4.31 658 561 A 20 TYR HE% A 24 MET HGx 1.0 . 4.81 659 561 A 20 TYR HE% A 24 MET HGy 1.0 . 4.81 660 562 A 21 LYS H A 21 LYS HBx 1.0 . 3.11 661 562 A 21 LYS H A 21 LYS HBy 1.0 . 3.11 662 563 A 21 LYS H A 21 LYS HGy 1.0 . 4.63 663 563 A 21 LYS H A 21 LYS HGx 1.0 . 4.63 664 564 A 22 GLN H A 21 LYS HBx 1.0 . 3.91 665 564 A 22 GLN H A 21 LYS HBy 1.0 . 3.91 666 565 A 22 GLN H A 22 GLN HBy 1.0 . 3.48 667 565 A 22 GLN H A 22 GLN HBx 1.0 . 3.48 668 566 A 22 GLN H A 22 GLN HGx 1.0 . 4.08 669 566 A 22 GLN H A 22 GLN HGy 1.0 . 4.08 670 567 A 22 GLN HA A 22 GLN HGx 1.0 . 3.68 671 567 A 22 GLN HA A 22 GLN HGy 1.0 . 3.68 672 568 A 22 GLN HA A 25 GLN HBx 1.0 . 3.84 673 568 A 22 GLN HA A 25 GLN HBy 1.0 . 3.84 674 569 A 22 GLN HA A 25 GLN HGx 1.0 . 4.20 675 569 A 22 GLN HA A 25 GLN HGy 1.0 . 4.20 676 570 A 23 ILE H A 22 GLN HBy 1.0 . 3.70 677 570 A 23 ILE H A 22 GLN HBx 1.0 . 3.70 678 571 A 26 PHE HD% A 22 GLN HBy 1.0 . 5.34 679 571 A 26 PHE HD% A 22 GLN HBx 1.0 . 5.34 680 572 A 39 TRP HH2 A 22 GLN HBy 1.0 . 5.03 681 572 A 22 GLN HBx A 39 TRP HH2 1.0 . 5.03 682 573 A 23 ILE H A 22 GLN HGx 1.0 . 4.08 683 573 A 23 ILE H A 22 GLN HGy 1.0 . 4.08 684 574 A 26 PHE HD% A 22 GLN HGx 1.0 . 5.34 685 574 A 26 PHE HD% A 22 GLN HGy 1.0 . 5.34 686 575 A 22 GLN HGy A 26 PHE HEy 1.0 . 4.39 687 575 A 26 PHE HEx A 22 GLN HGx 1.0 . 4.39 688 575 A 22 GLN HGx A 26 PHE HEy 1.0 . 4.39 689 575 A 26 PHE HEx A 22 GLN HGy 1.0 . 4.39 690 576 A 26 PHE HZ A 22 GLN HGx 1.0 . 4.90 691 576 A 26 PHE HZ A 22 GLN HGy 1.0 . 4.90 692 577 A 39 TRP HZ2 A 22 GLN HGx 1.0 . 4.53 693 577 A 39 TRP HZ2 A 22 GLN HGy 1.0 . 4.53 694 578 A 39 TRP HH2 A 22 GLN HGx 1.0 . 3.91 695 578 A 22 GLN HGy A 39 TRP HH2 1.0 . 3.91 696 579 A 24 MET H A 24 MET HBy 1.0 . 2.85 697 579 A 24 MET H A 24 MET HBx 1.0 . 2.85 698 580 A 24 MET H A 24 MET HGx 1.0 . 4.43 699 580 A 24 MET H A 24 MET HGy 1.0 . 4.43 700 581 A 24 MET HA A 27 ILE HG1x 1.0 . 3.51 701 581 A 24 MET HA A 27 ILE HG1y 1.0 . 3.51 702 582 A 24 MET HBx A 24 MET HGx 1.0 . 2.36 703 582 A 24 MET HBy A 24 MET HGx 1.0 . 2.36 704 582 A 24 MET HGy A 24 MET HBy 1.0 . 2.36 705 582 A 24 MET HBx A 24 MET HGy 1.0 . 2.36 706 583 A 25 GLN H A 24 MET HBy 1.0 . 4.07 707 583 A 25 GLN H A 24 MET HBx 1.0 . 4.07 708 584 A 25 GLN H A 24 MET HGx 1.0 . 5.18 709 584 A 25 GLN H A 24 MET HGy 1.0 . 5.18 710 585 A 25 GLN H A 25 GLN HBx 1.0 . 3.19 711 585 A 25 GLN H A 25 GLN HBy 1.0 . 3.19 712 586 A 25 GLN H A 25 GLN HGx 1.0 . 3.43 713 586 A 25 GLN H A 25 GLN HGy 1.0 . 3.43 714 587 A 25 GLN HBy A 25 GLN HE2x 1.0 . 4.58 715 587 A 25 GLN HBx A 25 GLN HE2x 1.0 . 4.58 716 587 A 25 GLN HE2y A 25 GLN HBx 1.0 . 4.58 717 587 A 25 GLN HBy A 25 GLN HE2y 1.0 . 4.58 718 588 A 26 PHE H A 25 GLN HBx 1.0 . 3.74 719 588 A 26 PHE H A 25 GLN HBy 1.0 . 3.74 720 589 A 26 PHE HD% A 25 GLN HBx 1.0 . 4.35 721 589 A 26 PHE HD% A 25 GLN HBy 1.0 . 4.35 722 590 A 25 GLN HBx A 26 PHE HEy 1.0 . 5.03 723 590 A 26 PHE HEx A 25 GLN HBx 1.0 . 5.03 724 590 A 25 GLN HBy A 26 PHE HEy 1.0 . 5.03 725 590 A 26 PHE HEx A 25 GLN HBy 1.0 . 5.03 726 591 A 26 PHE H A 26 PHE HBx 1.0 . 3.39 727 591 A 26 PHE H A 26 PHE HBy 1.0 . 3.39 728 592 A 27 ILE H A 26 PHE HBx 1.0 . 3.60 729 592 A 27 ILE H A 26 PHE HBy 1.0 . 3.60 730 593 A 31 TRP H A 26 PHE HBx 1.0 . 4.74 731 593 A 31 TRP H A 26 PHE HBy 1.0 . 4.74 732 594 A 31 TRP HBy A 26 PHE HBx 1.0 . 3.87 733 594 A 31 TRP HBy A 26 PHE HBy 1.0 . 3.87 734 595 A 31 TRP HE3 A 26 PHE HBx 1.0 . 4.83 735 595 A 31 TRP HE3 A 26 PHE HBy 1.0 . 4.83 736 596 A 36 ILE HD1% A 26 PHE HBx 1.0 . 4.16 737 596 A 36 ILE HD1% A 26 PHE HBy 1.0 . 4.16 738 597 A 27 ILE H A 27 ILE HG1x 1.0 . 3.14 739 597 A 27 ILE H A 27 ILE HG1y 1.0 . 3.14 740 598 A 27 ILE HA A 27 ILE HG1x 1.0 . 3.56 741 598 A 27 ILE HA A 27 ILE HG1y 1.0 . 3.56 742 599 A 27 ILE HG2% A 27 ILE HG1y 1.0 . 2.80 743 599 A 27 ILE HG2% A 27 ILE HG1x 1.0 . 2.80 744 600 A 28 GLY H A 27 ILE HG1x 1.0 . 4.84 745 600 A 28 GLY H A 27 ILE HG1y 1.0 . 4.84 746 601 A 36 ILE HD1% A 27 ILE HG1y 1.0 . 4.13 747 601 A 36 ILE HD1% A 27 ILE HG1x 1.0 . 4.13 748 602 A 29 GLN HA A 29 GLN HE2x 1.0 . 4.80 749 602 A 29 GLN HA A 29 GLN HE2y 1.0 . 4.80 750 603 A 29 GLN HE2x A 29 GLN HGx 1.0 . 3.33 751 603 A 29 GLN HE2y A 29 GLN HGx 1.0 . 3.33 752 603 A 29 GLN HGy A 29 GLN HE2x 1.0 . 3.33 753 603 A 29 GLN HGy A 29 GLN HE2y 1.0 . 3.33 754 604 A 31 TRP HE1 A 29 GLN HE2x 1.0 . 5.03 755 604 A 31 TRP HE1 A 29 GLN HE2y 1.0 . 5.03 756 605 A 31 TRP HD1 A 30 GLY HAy 1.0 . 5.25 757 605 A 31 TRP HD1 A 30 GLY HAx 1.0 . 5.25 758 606 A 31 TRP HE3 A 35 GLN HGy 1.0 . 5.18 759 606 A 31 TRP HE3 A 35 GLN HGx 1.0 . 5.18 760 607 A 33 ILE H A 33 ILE HG1x 1.0 . 3.71 761 607 A 33 ILE H A 33 ILE HG1y 1.0 . 3.71 762 608 A 33 ILE HG2% A 37 GLU HGy 1.0 . 4.51 763 608 A 33 ILE HG2% A 37 GLU HGx 1.0 . 4.51 764 609 A 34 ASP H A 33 ILE HG1x 1.0 . 4.60 765 609 A 34 ASP H A 33 ILE HG1y 1.0 . 4.60 766 610 A 35 GLN H A 35 GLN HGy 1.0 . 3.53 767 610 A 35 GLN H A 35 GLN HGx 1.0 . 3.53 768 611 A 35 GLN HA A 35 GLN HGy 1.0 . 3.72 769 611 A 35 GLN HA A 35 GLN HGx 1.0 . 3.72 770 612 A 35 GLN HA A 38 LYS HBx 1.0 . 3.88 771 612 A 35 GLN HA A 38 LYS HBy 1.0 . 3.88 772 613 A 36 ILE H A 35 GLN HGy 1.0 . 4.97 773 613 A 36 ILE H A 35 GLN HGx 1.0 . 4.97 774 614 A 37 GLU H A 37 GLU HGx 1.0 . 3.38 775 614 A 37 GLU H A 37 GLU HGy 1.0 . 3.38 776 615 A 37 GLU H A 38 LYS HBx 1.0 . 5.13 777 615 A 37 GLU H A 38 LYS HBy 1.0 . 5.13 778 616 A 37 GLU HA A 40 LEU HBx 1.0 . 4.17 779 616 A 37 GLU HA A 40 LEU HBy 1.0 . 4.17 780 617 A 38 LYS H A 37 GLU HBx 1.0 . 4.40 781 617 A 38 LYS H A 37 GLU HBy 1.0 . 4.40 782 618 A 38 LYS H A 37 GLU HGx 1.0 . 4.86 783 618 A 38 LYS H A 37 GLU HGy 1.0 . 4.86 784 619 A 38 LYS H A 38 LYS HBx 1.0 . 2.95 785 619 A 38 LYS H A 38 LYS HBy 1.0 . 2.95 786 620 A 38 LYS H A 38 LYS HGy 1.0 . 4.47 787 620 A 38 LYS H A 38 LYS HGx 1.0 . 4.47 788 621 A 38 LYS H A 38 LYS HDx 1.0 . 4.64 789 621 A 38 LYS H A 38 LYS HDy 1.0 . 4.64 790 622 A 38 LYS HA A 41 LYS HBy 1.0 . 4.45 791 622 A 38 LYS HA A 41 LYS HBx 1.0 . 4.45 792 623 A 39 TRP H A 38 LYS HBx 1.0 . 3.37 793 623 A 39 TRP H A 38 LYS HBy 1.0 . 3.37 794 624 A 40 LEU H A 40 LEU HBx 1.0 . 3.21 795 624 A 40 LEU H A 40 LEU HBy 1.0 . 3.21 796 625 A 40 LEU HDx% A 40 LEU HBx 1.0 . 3.68 797 625 A 40 LEU HDx% A 40 LEU HBy 1.0 . 3.68 798 626 A 40 LEU HDy% A 40 LEU HBx 1.0 . 3.59 799 626 A 40 LEU HDy% A 40 LEU HBy 1.0 . 3.59 800 627 A 41 LYS H A 40 LEU HBx 1.0 . 3.75 801 627 A 41 LYS H A 40 LEU HBy 1.0 . 3.75 802 628 A 41 LYS H A 41 LYS HBy 1.0 . 3.11 803 628 A 41 LYS H A 41 LYS HBx 1.0 . 3.11 804 629 A 41 LYS H A 41 LYS HGy 1.0 . 4.39 805 629 A 41 LYS H A 41 LYS HGx 1.0 . 4.39 806 630 A 42 ARG H A 41 LYS HBy 1.0 . 4.41 807 630 A 42 ARG H A 41 LYS HBx 1.0 . 4.41 808 631 A 42 ARG H A 43 HIS HBy 1.0 . 4.87 809 631 A 42 ARG H A 43 HIS HBx 1.0 . 4.87 stop_ save_